Glycoside
GD076990
Name:
NoneFormula:
C18H27O5N5Smiles:
CC[C@H]1CO[C@H](CC)CN1c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCC1CN(c2ncnc3c2N=C[N]3)C(CC)CO1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.72 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 5 |
| MolWt: | 393.44 | Num_heavy_atoms: | 28 |
| TPSA: | 125.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD35355
Formula: C13H18ON5
Smiles:
CCC1CN(c2ncnc3c2N=C[N]3)C(CC)CO1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.62 |
| AlogP: | 1.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 260.32 | Num_heavy_atoms: | 19 |
| TPSA: | 64.71 | NumAromaticRings: | 1 |
